HRID191614

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID18652

2,5-Dimethoxybenzylamine

C9H13NO2

结构：O=C1C2CCN(C(CCc3ccccc3)C2)C1C(c1ccccc1)c1ccccc1

HCID70118173

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(OC)c(CNC2C3CCN(C(CCc4ccccc4)C3)C2C(c2ccccc2)c2ccccc2)c1

HCID70117360

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0923b83dce944f20a6e044e1048c5f72
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH3:31][O:32][c:33]1[c:34]([CH2:35][NH2:36])[cH:37][c:38]([O:41][CH3:42])[cH:39][cH:40]1.[c:1]1([CH:7]([CH:8]2[N:9]3[CH:10]([CH2:17][CH2:18][c:19]4[cH:20][cH:21][cH:22][cH:23][cH:24]4)[CH2:11][CH:12]([C:13]2=[O:14])[CH2:15][CH2:16]3)[c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([CH:8]2[N:9]3[CH:10]([CH2:17][CH2:18][c:19]4[cH:20][cH:21][cH:22][cH:23][cH:24]4)[CH2:11][CH:12]([CH:13]2[NH:36][CH2:35][c:34]2[c:33]([O:32][CH3:31])[cH:40][cH:39][c:38]([O:41][CH3:42])[cH:37]2)[CH2:15][CH2:16]3)[c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1